Trithiozine
TL;DR: Trithiozine (CAS 35619-65-9) is a chemical compound with molecular formula C14H19NO4S and molecular weight 297.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
morpholin-4-yl-(3,4,5-trimethoxyphenyl)methanethione
Also Known As: Tritiozine, Trithiozine, Tresanil, Sulmetozine, Tritiozina
| Molecular Formula | C14H19NO4S |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.1035 |
| Heavy Atoms | 20 |
| Complexity | 308.0 |
| Solubility | >44.6 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 35619-65-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=S)N2CCOCC2 |
| InChIKey | MVOUIYUWRXPNKD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trithiozine (CAS 35619-65-9), with molecular formula C14H19NO4S and molecular weight 297.10 g/mol. IUPAC: morpholin-4-yl-(3,4,5-trimethoxyphenyl)methanethione.
Chemical Property Profile of Trithiozine
Property Insights of Trithiozine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trithiozine. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Trithiozine. Following Lipinski's Rule of Five, Trithiozine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trithiozine?
The CAS number of Trithiozine is 35619-65-9.
What is the molecular formula of Trithiozine?
The molecular formula of Trithiozine is C14H19NO4S.
What is the molecular weight of Trithiozine?
The molecular weight of Trithiozine is 297.10 g/mol.
Where can I buy Trithiozine?
You can request a quote for Trithiozine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trithiozine?
Yes, KEHONG BIO provides custom synthesis services for Trithiozine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.